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Home > Nitro Compounds > 88184-84-3
88184-84-3 | 2H-1-Benzopyran-2-one, 7-methoxy-3-nitro-
CAS No: 88184-84-3 Catalog No: AG004EV2 MDL No:
Product Description
Catalog Number:
AG004EV2
Chemical Name:
2H-1-Benzopyran-2-one, 7-methoxy-3-nitro-
CAS Number:
88184-84-3
Molecular Formula:
C10H7NO5
Molecular Weight:
221.1663
IUPAC Name:
7-methoxy-3-nitrochromen-2-one
InChI:
InChI=1S/C10H7NO5/c1-15-7-3-2-6-4-8(11(13)14)10(12)16-9(6)5-7/h2-5H,1H3
InChI Key:
UHOWQPKSOYGVKZ-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)oc(=O)c(c2)[N+](=O)[O-]
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.032g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.168g/mol
Monoisotopic Mass:
221.032g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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